6,10,14-trimethylpentadecan-2-one

(±)-Phytone
2-Pentadecanone, 6,10,14-trimethyl-
6,10,14-Trimethyl-2-pentadecanone
Hexahydrofarnesyl acetone
Perhydrofarnesyl acetone

Property	Value
InChI2D key string chemrof:inchi2d_key_string	WHWDWIHXSPCOKZ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C18H36O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h15-17H,6-14H2,1-5H3
IUPAC name chemrof:IUPAC_name	6,10,14-trimethylpentadecan-2-one
Molecular formula chemrof:molecular_formula	C18H36O
Molecular mass chemrof:molecular_mass	268.485
Monoisotopic mass chemrof:monoisotopic_mass	268.276616
SMILES string chemrof:smiles_string	CC(=O)CCCC(C)CCCC(C)CCCC(C)C

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=502-69-2	enrich_references.consensus_cas_link
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:145744	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.007.228	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID40862063	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/L8E8X8UZT6	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0303073	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J112.395E	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=163686	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/10408	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q67880075	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
2b84b8c7-6022-430a-89bf-fb5b4ff589c9	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
c4df6a1a-32e6-4140-a94f-70bb0669f692	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
17e2b006-d92f-4693-b983-d926ff94639d	Environmental → Air → Indoor	EF 3.1	kg	2
1c9dc8a7-1dd3-47c5-b610-916d5513eb4a	Environmental → Air → Long-term	EF 3.1	kg	0
820ff037-ce2f-4ede-9218-1c3b67e6bc5c	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
a1b43758-1240-4313-b29f-30e5a5b542a1	Environmental → Air → Unknown	EF 3.1	kg	2
d69f5e8f-3c57-4740-85c6-aa7c0b5ae1b3	Environmental → Ground → Agricultural	EF 3.1	kg	2
55b87056-850a-448c-a777-856c7a3e72f7	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
3d897efb-cfb5-4189-adb4-0f0fdaa2fefd	Environmental → Ground → Unknown	EF 3.1	kg	2
7aa30e93-3ed8-4957-aee6-60ad590dc1ac	Environmental → Water → Long-term	EF 3.1	kg	0
39916d59-1973-4f1a-9fb1-e80cb6760cb7	Environmental → Water → Ocean	EF 3.1	kg	2
f9d1c8de-d310-4570-a425-b5fb9ec04930	Environmental → Water → Surface water	EF 3.1	kg	2
9c624511-0886-4ea4-93ff-365d426fc458	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-0e74995365031526",
  "prefLabel": [
    {
      "@value": "6,10,14-trimethylpentadecan-2-one",
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  "altLabel": [
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      "@value": "(±)-Phytone",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
      "@value": "2-Pentadecanone, 6,10,14-trimethyl-",
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      "@value": "6,10,14-Trimethyl-2-pentadecanone",
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}

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6,10,14-trimethylpentadecan-2-one

Identity

Structure

Alternative labels

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Known URLs

Elementary flows

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